N-cyclopropyl-1-propan-2-yltetrazol-5-amine

C7H13N5 — CID 57332420

IUPACN-cyclopropyl-1-propan-2-yltetrazol-5-amine
SMILESCC(C)n1nnnc1NC1CC1
InChIInChI=1S/C7H13N5/c1-5(2)12-7(9-10-11-12)8-6-3-4-6/h5-6H,3-4H2,1-2H3,(H,8,9,11)
InChIKeyNTYSEPZNDWAJLF-UHFFFAOYSA-N
MW167.22 g/mol
LogP0.83
Rot. Bonds3

About N-cyclopropyl-1-propan-2-yltetrazol-5-amine

N-cyclopropyl-1-propan-2-yltetrazol-5-amine (PubChem CID 57332420) has the molecular formula C7H13N5 and a molecular weight of 167.22 g/mol. Its IUPAC name is N-cyclopropyl-1-propan-2-yltetrazol-5-amine.

Molecular Properties

Compound NameN-cyclopropyl-1-propan-2-yltetrazol-5-amine
PubChem CID57332420
Molecular FormulaC7H13N5
Molecular Weight167.22 g/mol
Exact Mass167.12
IUPAC NameN-cyclopropyl-1-propan-2-yltetrazol-5-amine
SMILESCC(C)n1nnnc1NC1CC1
InChIInChI=1S/C7H13N5/c1-5(2)12-7(9-10-11-12)8-6-3-4-6/h5-6H,3-4H2,1-2H3,(H,8,9,11)
InChIKeyNTYSEPZNDWAJLF-UHFFFAOYSA-N
XLogP0.83
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.22
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-propan-2-yltetrazol-5-amine?
The IUPAC name of N-cyclopropyl-1-propan-2-yltetrazol-5-amine (CID 57332420) is N-cyclopropyl-1-propan-2-yltetrazol-5-amine.
What is the SMILES notation for N-cyclopropyl-1-propan-2-yltetrazol-5-amine?
The canonical SMILES for N-cyclopropyl-1-propan-2-yltetrazol-5-amine is CC(C)n1nnnc1NC1CC1.
What is the InChIKey of N-cyclopropyl-1-propan-2-yltetrazol-5-amine?
The InChIKey is NTYSEPZNDWAJLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N5/c1-5(2)12-7(9-10-11-12)8-6-3-4-6/h5-6H,3-4H2,1-2H3,(H,8,9,11).
What are the key properties of N-cyclopropyl-1-propan-2-yltetrazol-5-amine?
N-cyclopropyl-1-propan-2-yltetrazol-5-amine has a molecular weight of 167.22 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-propan-2-yltetrazol-5-amine is sourced from PubChem (CID 57332420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).